N-[3-(1,3-benzodioxol-5-yl)-6-chloranyl-2-methyl-4H-pyrimidin-5-yl]benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-yl)-6-chloranyl-2-methyl-4H-pyrimidin-5-yl]benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidin-5-yl]benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidin-5-yl]benzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidin-5-yl]benzenesulfonamide Traditional Name: N-[3-(1,3-benzodioxol-5-yl)-6-chloro-2-methyl-4H-pyrimidin-5-yl]benzenesulfonamide Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(CN1C2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=NC(=C(CN1C2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C18H16ClN3O4S/c1-12-20-18(19)15(21-27(23,24)14-5-3-2-4-6-14)10-22(12)13-7-8-16-17(9-13)26-11-25-16/h2-9,21H,10-11H2,1H3